SCHEMBL5344217

SCHEMBL5344217

O=C(NCCc1ccccc1)c1c(-c2ccc(Cl)cc2)ccn2ccnc12

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.51
ALDH1A1 P00352 1/20 0.51
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
MAPT P10636 4/20 0.46
MEN1 O00255 2/20 0.46
HTT P42858 1/20 0.46
HIF1A Q16665 2/20 0.46
TP53 P04637 2/20 0.46
CCNA2 P20248 1/20 0.45
CDK2 P24941 1/20 0.45
POLB P06746 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
THRB P10828 1/20 0.44
TAAR1 Q96RJ0 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5335055 0.84 NAMPT (0.46) LMNAALDH1A1KMT2ASMN1; SMN2RAB9A
SCHEMBL5318651 0.79 HDAC1 (0.50) RAB9AMAPTTP53POLBRXFP1
SCHEMBL5333974 0.78 NPC1 (0.47) ALDH1A1SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL5338080 0.76 P2RX7 (0.46) KMT2ARAB9ANPC1MEN1HTT
SCHEMBL5339245 0.76 CNR1 (0.43) KMT2ARAB9ANPC1MAPTTP53
SCHEMBL5344215 0.69 DHODH (0.56) LMNAALDH1A1KMT2ARAB9ANPC1
SCHEMBL28551980 0.69 RAB9A (0.74) LMNAKMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL15529130 0.68 KDM4E (0.48) LMNAALDH1A1KMT2ASMN1; SMN2RAB9A
SCHEMBL28601911 0.67 HIF1A (0.85) LMNAKMT2ARAB9ANPC1MAPT
SCHEMBL8163393 0.67 MCHR1 (0.77) LMNAALDH1A1KMT2ASMN1; SMN2RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007086080-A2 NOVEL IMIDAZO[1,2-a]PYRIDINE CANNABINOID RECEPTOR LIGANDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LIMITED (IN) 2007-08-02 WO claimed
WO-2007086080-A2 NOVEL IMIDAZO[1,2-a]PYRIDINE CANNABINOID RECEPTOR LIGANDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LIMITED (IN) 2007-08-02 WO disclosed